Density-functional tight-binding: basic concepts and applications to molecules and clusters
密度泛函紧束缚:基本概念及其在分子和团簇中的应用
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doi:10.1080/23746149.2019.1710252
Spiegelman, Fernand; Tarrat, Nathalie; Cuny, Jérôme; Dontot, Leo; Posenitskiy, Evgeny; Martí, Carles; Simon, Aude; Rapacioli, Mathias